2-[(4-bromo-2-methylphenyl)methoxy]phenol

C14H13BrO2 — CID 117219489

IUPAC2-[(4-bromo-2-methylphenyl)methoxy]phenol
SMILESCc1cc(Br)ccc1COc1ccccc1O
InChIInChI=1S/C14H13BrO2/c1-10-8-12(15)7-6-11(10)9-17-14-5-3-2-4-13(14)16/h2-8,16H,9H2,1H3
InChIKeyRAYWPLSHTGFKBD-UHFFFAOYSA-N
MW293.16 g/mol
LogP4.04
Rot. Bonds3

About 2-[(4-bromo-2-methylphenyl)methoxy]phenol

2-[(4-bromo-2-methylphenyl)methoxy]phenol (PubChem CID 117219489) has the molecular formula C14H13BrO2 and a molecular weight of 293.16 g/mol. Its IUPAC name is 2-[(4-bromo-2-methylphenyl)methoxy]phenol.

Molecular Properties

Compound Name2-[(4-bromo-2-methylphenyl)methoxy]phenol
PubChem CID117219489
Molecular FormulaC14H13BrO2
Molecular Weight293.16 g/mol
Exact Mass292.01
IUPAC Name2-[(4-bromo-2-methylphenyl)methoxy]phenol
SMILESCc1cc(Br)ccc1COc1ccccc1O
InChIInChI=1S/C14H13BrO2/c1-10-8-12(15)7-6-11(10)9-17-14-5-3-2-4-13(14)16/h2-8,16H,9H2,1H3
InChIKeyRAYWPLSHTGFKBD-UHFFFAOYSA-N
XLogP4.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.16
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(4-bromo-2-methylphenoxy)methyl]-3-methylbenzoic acid
CID 114485775
2-[(2-bromophenoxy)methyl]-5-methylphenol
CID 117221024
3-[(4-fluoro-2-methylphenyl)methoxy]-2-methylphenol
CID 114346383
O-[(4-bromo-2-methylphenyl)methyl]hydroxylamine
CID 20595379
2-bromo-1-[2-[(4-bromo-2-methylphenyl)methoxy]-5-methylphenyl]ethanone
CID 89407372
5-bromo-2-[(4-bromo-2-methylphenoxy)methyl]aniline
CID 114380845
N-[[2-[(4-bromo-2-methylphenoxy)methyl]phenyl]methyl]ethanamine
CID 63496855
4-bromo-1-(ethoxymethyl)-2-methylbenzene
CID 117219809
3-fluoro-4-[(2-hydroxyphenoxy)methyl]phenol
CID 117219510
[4-[(2-bromophenoxy)methyl]-3-methylphenyl]methanamine
CID 114479347
5-bromo-2-[(4-fluoro-2-methylphenyl)methoxy]benzaldehyde
CID 114346022
4-bromo-1-(2-methoxypropan-2-yloxymethyl)-2-methylbenzene
CID 143914148

Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromo-2-methylphenyl)methoxy]phenol?
The IUPAC name of 2-[(4-bromo-2-methylphenyl)methoxy]phenol (CID 117219489) is 2-[(4-bromo-2-methylphenyl)methoxy]phenol.
What is the SMILES notation for 2-[(4-bromo-2-methylphenyl)methoxy]phenol?
The canonical SMILES for 2-[(4-bromo-2-methylphenyl)methoxy]phenol is Cc1cc(Br)ccc1COc1ccccc1O.
What is the InChIKey of 2-[(4-bromo-2-methylphenyl)methoxy]phenol?
The InChIKey is RAYWPLSHTGFKBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrO2/c1-10-8-12(15)7-6-11(10)9-17-14-5-3-2-4-13(14)16/h2-8,16H,9H2,1H3.
What are the key properties of 2-[(4-bromo-2-methylphenyl)methoxy]phenol?
2-[(4-bromo-2-methylphenyl)methoxy]phenol has a molecular weight of 293.16 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromo-2-methylphenyl)methoxy]phenol is sourced from PubChem (CID 117219489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).